N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine

C10H20N2 — CID 116680413

IUPACN-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine
SMILESCC1CC(NCCC2CNC2)C1
InChIInChI=1S/C10H20N2/c1-8-4-10(5-8)12-3-2-9-6-11-7-9/h8-12H,2-7H2,1H3
InChIKeyFNUQXSJXRXJUMG-UHFFFAOYSA-N
MW168.28 g/mol
LogP0.98
Rot. Bonds4

About N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine

N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine (PubChem CID 116680413) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine.

Molecular Properties

Compound NameN-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine
PubChem CID116680413
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine
SMILESCC1CC(NCCC2CNC2)C1
InChIInChI=1S/C10H20N2/c1-8-4-10(5-8)12-3-2-9-6-11-7-9/h8-12H,2-7H2,1H3
InChIKeyFNUQXSJXRXJUMG-UHFFFAOYSA-N
XLogP0.98
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,3-difluoroazetidine;N,3-dimethylcyclobutan-1-amine;hydrochloride
CID 158420686
(1S,2S,3S)-2-fluoro-3-methyl-N-propan-2-ylcyclobutan-1-amine
CID 176924922
(1R,2R,3R)-2-fluoro-3-methyl-N-propan-2-ylcyclobutan-1-amine
CID 176925167
N-tert-butyl-3-methylcyclobutan-1-amine
CID 10725445
N-(3-fluoropropyl)-3-methylcyclobutan-1-amine
CID 116014841
N-(1-fluoropropan-2-yl)-3-methylcyclobutan-1-amine
CID 130660217
3-fluoro-3-methyl-N-(2-methylpropyl)cyclobutan-1-amine
CID 167569034
N-(4-methylpentan-2-yl)cyclobutanamine
CID 21355608
N-(3-methylbutyl)cyclobutanamine
CID 22367458
1-(1-Propan-2-ylazetidin-3-yl)ethanamine
CID 22896250
N-methyl-1-(1-propan-2-ylazetidin-3-yl)ethanamine
CID 22896253
2-(1-Propan-2-ylazetidin-3-yl)propan-1-amine
CID 22896269

Frequently Asked Questions

What is the IUPAC name of N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine?
The IUPAC name of N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine (CID 116680413) is N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine.
What is the SMILES notation for N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine?
The canonical SMILES for N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine is CC1CC(NCCC2CNC2)C1.
What is the InChIKey of N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine?
The InChIKey is FNUQXSJXRXJUMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-8-4-10(5-8)12-3-2-9-6-11-7-9/h8-12H,2-7H2,1H3.
What are the key properties of N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine?
N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine has a molecular weight of 168.28 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(azetidin-3-yl)ethyl]-3-methylcyclobutan-1-amine is sourced from PubChem (CID 116680413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).